SCHEMBL21708259

SCHEMBL21708259

CCCOCCS(N)(=O)=O

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA2 P00918 18/20 0.48
CA1 P00915 16/20 0.48
CA9 Q16790 10/20 0.38
CA12 O43570 7/20 0.37
CA7 P43166 6/20 0.37
CA14 Q9ULX7 5/20 0.37
CA3 P07451 2/20 0.37
CA4 P22748 2/20 0.37
CA6 P23280 2/20 0.37
CA5A P35218 2/20 0.37
CA5B Q9Y2D0 2/20 0.37
TSHR P16473 1/20 0.31
HSD17B10 Q99714 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL21708336 0.86 CA2 (0.52) CA2CA1CA9CA12CA7
SCHEMBL21708223 0.86 CA2 (0.44) CA2CA1CA9CA12CA7
SCHEMBL6277726 0.83 CA2 (0.39) CA2CA1CA9CA12CA7
SCHEMBL6285121 0.83 CA2 (0.39) CA2CA1CA9CA12CA7
SCHEMBL6171423 0.82
SCHEMBL4359971 0.79 CA2 (0.40) CA2CA1CA9CA12CA7
SCHEMBL6222747 0.78 CA2 (0.59) CA2CA1CA9CA7CA5A
SCHEMBL6277563 0.78 CA2 (0.59) CA2CA1CA9CA7CA5A
SCHEMBL6277779 0.78 CA2 (0.59) CA2CA1CA9CA7CA5A
SCHEMBL13251209 0.77

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11819476-B2 Rapamycin analogs and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2023-11-21 US disclosed
EP-3611175-B1 NAPHTHALOCYANINE COMPOUND, METHOD FOR PRODUCING SAME, AND USE THEREOF YAMAMOTO CHEMICALS INC (JP) 2022-02-09 EP disclosed
US-11174274-B2 Naphthalocyanine compound, method for producing same, and use thereof YAMAMOTO CHEMICALS, INC. (JP) 2021-11-16 US disclosed
US-20210107924-A1 NAPHTHALOCYANINE COMPOUND, METHOD FOR PRODUCING SAME, AND USE THEREOF YAMAMOTO CHEMICALS, INC. (JP) 2021-04-15 US disclosed
EP-3611175-A1 NAPHTHALOCYANINE COMPOUND, METHOD FOR PRODUCING SAME, AND USE THEREOF Yamamoto Chemicals, Inc. (JP) 2020-02-19 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210107924-A1 NAPHTHALOCYANINE COMPOUND, METHOD FOR PRODUCING SAME, AND USE THEREOF MRPS9, INTS9, RPL19 CA2 1085/4885CA1 734/4885CA9 59/4885
US-11819476-B2 Rapamycin analogs and uses thereof RICTOR, MTOR, RPTOR CA2 4422/4885CA1 4798/4885CA9 4211/4885
US-11174274-B2 Naphthalocyanine compound, method for producing same, and use thereof MRPS9, INTS9, RPL19 CA2 1085/4885CA1 734/4885CA9 59/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.